Dataset
attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
Chemical Info
InChI | InChI=1S/C39H32OP2.C12H8N3S.Cu/c1-39(2)33-25-15-27-35(41(29-17-7-3-8-18-29)30-19-9-4-10-20-30)37(33)40-38-34(39)26-16-28-36(38)42(31-21-11-5-12-22-31)32-23-13-6-14-24-32;1-2-6-11-10(5-1)15-12(16-11)14-8-9-4-3-7-13-9;/h3-28H,1-2H3;1-8H;/q;-1;+1/b;14-8+; |
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SMILES | CC1(C)c2cccc(c2Oc2c1cccc2P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1.[Cu]n1cccc1/C=N/c1nc2c(s1)cccc2 |
InChI Key | COWMTQZWFSSWOZ-TXTNVABFSA-N |
Molecular Formula | C51H40CuN3OP2S |
Exact Mass | 868.441 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/COWMTQZWFSSWOZ-TXTNVABFSA-N/CHMO0000763 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/COWMTQZWFSSWOZ-TXTNVABFSA-N/CHMO0000763 |
Version | |
Author | Valentina Ferraro |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T03:16:15.901497 |
MetadataModified | 2024-09-08T03:16:15.901504 |
MetadataPublished | 2024-04-17 |
Field | Value |
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Measurement Technique | attenuated total reflectance Fourier transform infrared spectroscopy |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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No additional information available for this Dataset. |